Computer simulations of n-alkane melts
- R.G. Winkler
- P.J. Ludovice
- et al.
- 1991
- The Journal of Chemical Physics
Paper
Publications
954 results at The Journal of Chemical Physics
Calculations on the rate of the ion-molecule reaction between NH 3+ and H2
- Eric Herbst
- D.J. DeFrees
- et al.
- 1991
- The Journal of Chemical Physics
PaperTheoretical study of molten KSi
- Giulia Galli
- Michele Parrinello
- 1991
- The Journal of Chemical Physics
PaperAll electron versus pseudopotentials in ab initio chemisorption cluster model calculations
- Francesc Illas
- Paul S. Bagus
- 1991
- The Journal of Chemical Physics
PaperThe determination of accurate dipole polarizabilities α and γ for the noble gases
- Julia E. Rice
- Peter R. Taylor
- et al.
- 1991
- The Journal of Chemical Physics
PaperA theoretical study of Na(H2O)n+ (n = 1-4)
- Charles W. Bauschlicher Jr.
- Stephen R. Langhoff
- et al.
- 1991
- The Journal of Chemical Physics
PaperMutual polarization of monomer charge distribution in (HCN)2, (HCN)3, and (HCN)∞
- R.S. Ruoff
- 1991
- The Journal of Chemical Physics
PaperStructural study of a new Langmuir-Blodgett material designed for nonlinear optical applications
- N.J. Geddes
- M. Jurich
- et al.
- 1991
- The Journal of Chemical Physics
PaperDesorption kinetics of hydrogen from the Si(111)7x7 surface
- G.A. Reider
- U. Höfer
- et al.
- 1991
- The Journal of Chemical Physics
PaperSelected versus complete configuration interaction expansions
- F. Illas
- J. Rubio
- et al.
- 1991
- The Journal of Chemical Physics
Paper